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canSAR1617431
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NAMES
    SMILES
    O=C(c1ccccc1F)N1CCC2CC1c1cc(-c3ccc4c(c3)OCO4)ccc12
    InChI
    InChI=1S/C25H20FNO3/c26-21-4-2-1-3-19(21)25(28)27-10-9-17-12-22(27)20-11-15(5-7-18(17)20)16-6-8-23-24(13-16)30-14-29-23/h1-8,11,13,17,22H,9-10,12,14H2
    MOLECULAR FORMULA
    C25H20FNO3
    CROSS REFERENCES
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    canSAR1617431

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 401.14
    AlogP 5.30
    HBond donors 0
    HBond acceptors 4
    Atoms 50
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1617431.